| Name |
Caffeine
Caffein |
| Formula |
C8H10N4O2 |
| Mw |
194.08037559 |
| CAS RN |
58-08-2 |
| C_ID |
C00001492
, 
|
| InChIKey |
RYYVLZVUVIJVGH-UHFFFAOYSA-N |
| InChICode |
InChI=1S/C8H10N4O2/c1-10-4-9-6-5(10)7(13)12(3)8(14)11(6)2/h4H,1-3H3 |
| SMILES |
n1(c(=O)n(c2c(c1=O)n(cn2)C)C)C |
| Start Substs in Alk. Biosynthesis (Prediction) |
L-Tyr L-Asp L-Phe |
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Animalia | Hominidae | Homo sapiens (Urine) | Ref. |
| Plantae | Aquifoliaceae | Ilex cornuta  | Ref. |
| Plantae | Aquifoliaceae | Ilex paraguariensis | Ref. |
| Plantae | Aquifoliaceae | Ilex paraguayensis | Ref. |
| Plantae | Caricaceae | Carica papaya | Ref. |
| Plantae | Loranthaceae | Scurrula atropurpurea | Ref. |
| Plantae | Malvaceae | Cola acuminata | Ref. |
| Plantae | Malvaceae | Cola sp. | Ref. |
| Plantae | Malvaceae | Cola spp. | Ref. |
| Plantae | Malvaceae | Firmiana simplex | Ref. |
| Plantae | Malvaceae | Theobroma cacao | Ref. |
| Plantae | Malvaceae | Theobroma grandiflorum | Ref. |
| Plantae | Rubiaceae | Coffea arabica | Ref. |
| Plantae | Rubiaceae | Coffea canephora | Ref. |
| Plantae | Rubiaceae | Coffea dewevrei | Ref. |
| Plantae | Rubiaceae | Coffea eugeniodes | Ref. |
| Plantae | Rubiaceae | Coffea eugenioides | Ref. |
| Plantae | Rubiaceae | Coffea excelsa | Ref. |
| Plantae | Rubiaceae | Coffea kianjavatensis | Ref. |
| Plantae | Rubiaceae | Coffea liberica | Ref. |
| Plantae | Rubiaceae | Coffea racemosa | Ref. |
| Plantae | Rubiaceae | Coffea salvatrix | Ref. |
| Plantae | Rubiaceae | Coffea spp | Ref. |
| Plantae | Rubiaceae | Coffea spp. | Ref. |
| Plantae | Rutaceae | Citrus limon | Ref. |
| Plantae | Rutaceae | Citrus maxima | Ref. |
| Plantae | Rutaceae | Citrus paradisi | Ref. |
| Plantae | Sapindaceae | Paullinia cupana | Ref. |
| Plantae | Sapindaceae | Paullinia trifoliata | Ref. |
| Plantae | Theaceae | Camellia assamica | Ref. |
| Plantae | Theaceae | Camellia irawadiensis | Ref. |
| Plantae | Theaceae | Camellia kissi | Ref. |
| Plantae | Theaceae | Camellia sinensis | Ref. |
| Plantae | Theaceae | Camellia sinensis var. sinensis | Ref. |
| Plantae | Theaceae | Camellia taliensis | Ref. |
| Plantae | Theaceae | Camellia thea | Ref. |
| Plantae | Theaceae | Camellia toliensis | Ref. |
| Plantae | Theaceae | Thea siensis | Ref. |
| - | - | Cammellia assamica var.kucha | Ref. |
| - | - | Coffea, Thea | Ref. |
| - | - | Coffee arabica | Ref. |
| - | - | Herreania sp. | Ref. |
| - | - | Scurrura atropurpurea | Ref. |
|
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zoom in
| Organism | Coffea excelsa |
|---|
| Reference | Chang, et al., Dictionary of Chemistry, Science Press, Beijing, (2008).
OHASHI, et al., Chem Pharm Bull, 51, (2003), 343.
Chinese Materia Medica Editing Committee of the National Chinese Medicine and Pharmacology Bureau, Chinese Materia Medica (ZHONG HUA BEN CAO), Vol.1-Vol.30, Shanghai Science and technology Press, Shanghai, (1999).
Wang, et al., Handbook of Effective Components in Vegetal Medicines, People Health Press, Beijing, (1986).
Ji, et al., Pharmacological Action and Application of Available Composition of Traditional Chinese Medicine, Heilongjiang Science and technology Press, Heilongjiang, (1995).
Edited by Jiangsu New Medicinal College, Chinese Medicine Dictionary, Shanghai Science and technology Press, Shanghai, (1979). |
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